2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-pentan-2-yl-propanamide

Systemtic Name: 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-pentan-2-yl-propanamide Openeye Name: 2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-N-(1-methylbutyl)propanamide CAS Name: 2-[[2-(4-methylanilino)-2-oxoethyl]thio]-N-pentan-2-ylpropanamide IUPAC Name: 2-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-N-pentan-2-ylpropanamide Traditional Name: 2-[[2-keto-2-(p-toluidino)ethyl]thio]-N-(1-methylbutyl)propionamide Formula: C17H26N2O2S MolecularWeight: 322.46554

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C(C)SCC(=O)NC1=CC=C(C=C1)C

Isomeric SMILES

CCCC(C)NC(=O)C(C)SCC(=O)NC1=CC=C(C=C1)C

InChI

InChI=1S/C17H26N2O2S/c1-5-6-13(3)18-17(21)14(4)22-11-16(20)19-15-9-7-12(2)8-10-15/h7-10,13-14H,5-6,11H2,1-4H3,(H,18,21)(H,19,20)